SCHEMBL9861673

SCHEMBL9861673

CCCC(Nc1nc(NCCCO)nc(NCCCO)n1)C1CC(C)(C)NC(C)(C)C1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNH3 Q9ULD8 5/20 0.35
KMT2A Q03164 1/20 0.35
SLC29A1 Q99808 1/20 0.33
CDK1 P06493 2/20 0.32
CDK2 P24941 2/20 0.32
GBA1 P04062 1/20 0.32
TYRO3 Q06418 2/20 0.30
MERTK Q12866 2/20 0.30
GAS6 Q14393 2/20 0.30
AXL P30530 1/20 0.30
FLT3 P36888 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10907329 1.00 KCNH3 (0.35) KCNH3KMT2ASLC29A1CDK1CDK2
SCHEMBL11101373 0.93 KMT2A (0.36) KMT2ASLC29A1GBA1
SCHEMBL10910182 0.92 KMT2A (0.41) KCNH3KMT2ASLC29A1CDK1CDK2
SCHEMBL10813594 0.92 KCNH3 (0.31) KCNH3KMT2ACDK1CDK2
SCHEMBL9367801 0.92 KCNH3 (0.35) KCNH3KMT2A
SCHEMBL7481323 0.86 IDH1 (0.34)
SCHEMBL294893 0.86 SLC29A1 (0.31) SLC29A1
SCHEMBL11203827 0.85 GAA (0.35)
SCHEMBL7945319 0.84
SCHEMBL8838268 0.83 IDH1 (0.31)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0176604-B1 HIGH-MOLECULAR PIPERIDINE GROUPS CONTAINED IN ESTERS, PROCESS FOR THEIR PREPARATION, THEIR USE AS STABILISERS FOR POLYMERS AND POLYMERS CONTAINING THEM HOECHST AKTIENGESELLSCHAFT (DE) 1991-06-12 EP disclosed
EP-0176604-A2 High-molecular piperidine groups contained in esters, process for their preparation, their use as stabilisers for polymers and polymers containing them HOECHST AKTIENGESELLSCHAFT (DE) 1986-04-09 EP disclosed
US-4476302-A PHOTOSTABILITY HOECHST AKTIENGESELLSCHAFT (DE) 1984-10-09 US disclosed
EP-0061659-A1 Piperidine groups containing esters,methods for their preparation, their use as stabilising agents for polymers, and polymers containing these compounds HOECHST AKTIENGESELLSCHAFT (DE) 1982-10-06 EP disclosed